SCHEMBL124460

SCHEMBL124460

CCOC(F)(F)c1nc2nc(C)c(F)cc2cc1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
KDM4E B2RXH2 4/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GFER P55789 1/20 0.31
ALDH1A1 P00352 4/20 0.31
HPGD P15428 2/20 0.31
CYP1A2 P05177 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL124157 0.89 GFER (0.33) GFER
SCHEMBL127612 0.87 HCAR2 (0.32)
SCHEMBL123990 0.86 ALDH1A1 (0.33) KDM4EGFERALDH1A1HPGDHSD17B10
SCHEMBL126280 0.83 GFER (0.43) KDM4ENPSR1GFERALDH1A1MEN1
SCHEMBL124252 0.83 GFER (0.31) GFERALDH1A1MEN1KMT2AKEAP1
SCHEMBL126801 0.82 HPD (0.33) ALDH1A1CYP1A2
SCHEMBL122914 0.81 KDM4E (0.40) TSHRKDM4ENPSR1ALDH1A1HPGD
SCHEMBL123356 0.81 MEN1 (0.36) KDM4EGFERALDH1A1SMN1; SMN2MEN1
SCHEMBL3432223 0.81 GFER (0.34) KDM4EGFERALDH1A1MEN1KMT2A
SCHEMBL124857 0.81 GFER (0.31) GFERALDH1A1MEN1KMT2AKEAP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461083-B2 Herbicidal compounds SYNGENTA LIMITED (GB) 2013-06-11 US disclosed
EP-2265120-B1 HERBICIDAL COUMPOUNDS SYNGENTA LTD (GB) 2012-03-07 EP disclosed
US-20110021352-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-01-27 US disclosed
EP-2265120-A1 HERBICIDAL COUMPOUNDS Syngenta Limited (GB) 2010-12-29 EP disclosed
WO-2009115788-A1 HERBICIDAL COUMPOUNDS SYNGENTA LIMITED (GB) 2009-09-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110021352-A1 HERBICIDAL COMPOUNDS RDX, NQO2, DDT TSHR 1704/4885KDM4E 1231/4885NPSR1 683/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.